Crystallography Open Database

Information card for entry 7209777

7209776 << 7209777 >> 7209778

Preview

Coordinates	7209777.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C200 H240 Cd7 Cl2 N16 O68
Calculated formula	C200 H240 Cd7 Cl2 N16 O68
Title of publication	Syntheses, structures and luminescence properties of novel metal‒organic frameworks based on zinc(ii), cadmium(ii) or lead(ii) and a 2,2′-dimethoxy-functionalised biphenyl linker
Authors of publication	Lestari, Witri Wahyu; Lönnecke, Peter; Sárosi, Menyhárt B.; Streit, Huayna Cerqueira; Adlung, Matthias; Wickleder, Claudia; Handke, Marcel; Einicke, Wolf-Dietrich; Gläser, Roger; Hey-Hawkins, Evamarie
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	19
Pages of publication	3874
a	22.3139 ± 0.0002 Å
b	22.3139 ± 0.0002 Å
c	43.2016 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	21510.5 ± 0.5 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
Space group number	122
Hermann-Mauguin space group symbol	I -4 2 d
Hall space group symbol	I -4 2bw
Residual factor for all reflections	0.1195
Residual factor for significantly intense reflections	0.0526
Weighted residual factors for significantly intense reflections	0.1176
Weighted residual factors for all reflections included in the refinement	0.1295
Goodness-of-fit parameter for all reflections included in the refinement	0.817
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180428 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/97.	7209777.cif
86095	2013-05-09	cif/ Adding structures of 7209776, 7209777, 7209778, 7209779 via cif-deposit CGI script.	7209777.cif